Geometry & MOs

Info

ID:	62259
PubChem CID:	26718683
Reduced:	O4N5C24H35 (1)
Stoich.:	A4B5C24D35 (1)
Weight, g/mol:	489.092533
ΔH_f, kcal/mol:	-197.52
Dipole, Da:	4.45
IP(EA), eV:	-8.46(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-[2-(2,5-dimethylanilino)-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)NC(=O)CCC(=O)N(CC(C)C)C2=C(N(C(=O)NC2=O)CC(C)C)N

DOS

IR

Vibrations